2,5-dichloro-3-methyl-muconate

Properties Image MNX_ID MNXM8043 reference metacycM:CPD-10853 formula C7H4Cl2O4 global charge -2 mol weight 223.011 InChIKey VZTAXNZJLYAMBI-ZUVMSYQZSA-L InChI InChI=1S/C7H6Cl2O4/c1-3(5(9)7(12)13)2-4(8)6(10)11/h2H,1H3,(H,10,11)(H,12,13)/p-2/b4-2+,5-3+ SMILES CC(/C=C(/Cl)C(=O)[O-])=C(\Cl)C(=O)[O-] MNX internals InChI (mnx) InChI=1/C7H6Cl2O4/c1-3(5(9)7(12)13)2-4(8)6(10)11/h2H,1H3,(H,10,11)(H,12,13)/b4-2+,5-3+ SMILES (mnx) [CH3:1][C:3](/[CH:2]=[C:4](\[C:6](=[O:10])[OH:11])[Cl:8])=[C:5](/[C:7](=[O:12])[OH:13])[Cl:9]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 3 in models (compartimentalized) 0